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  1. Third-Parties
  2. MatprojStructure
  3. mp-1257812

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1257812
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 49
  • Number of elements: 5
  • Element list: ['Y', 'Ti', 'Si', 'Sb', 'O']
  • Chemical System: O-Sb-Si-Ti-Y
  • Density: 4.746308081340394
  • Atomic Density: 0.08116535227493805
  • Unit Cell Volume: 603.7058748173516
  • Molar Volume: 7.419595419977615
  • Full Formula: Y4 Ti13 Si2 Sb2 O28
  • Reduced Formula: Y4Ti13Si2(SbO14)2
  • Formula Anonymous: A2B2C4D13E28
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -434.0648773
  • Final energy per atom: -8.858466883673469
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.